1,1-bis(3-methylbutyl)-3-(3-pyridin-4-ylpropyl)urea

Systemtic Name: 1,1-bis(3-methylbutyl)-3-(3-pyridin-4-ylpropyl)urea Openeye Name: 1,1-diisopentyl-3-[3-(4-pyridyl)propyl]urea CAS Name: 1,1-bis(3-methylbutyl)-3-(3-pyridin-4-ylpropyl)urea IUPAC Name: 1,1-bis(3-methylbutyl)-3-(3-pyridin-4-ylpropyl)urea Traditional Name: 1,1-diisoamyl-3-[3-(4-pyridyl)propyl]urea Formula: C19H33N3O MolecularWeight: 319.48482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CCC(C)C)C(=O)NCCCC1=CC=NC=C1

Isomeric SMILES

CC(C)CCN(CCC(C)C)C(=O)NCCCC1=CC=NC=C1

InChI

InChI=1S/C19H33N3O/c1-16(2)9-14-22(15-10-17(3)4)19(23)21-11-5-6-18-7-12-20-13-8-18/h7-8,12-13,16-17H,5-6,9-11,14-15H2,1-4H3,(H,21,23)